Water → HCID 178449815, compound

HRID 2324923Notes

Reaction equation

HRID 2324923 reaction equation
[C:8]([CH3:9])([CH3:10])([CH3:11])[O:12][C:13](=[O:14])[NH:15][CH:16]([CH:17]([CH3:18])[CH3:19])[C:20](=[O:21])[OH:22].[CH2:41]([Cl:42])[Cl:43].[CH3:1][N:2]1[CH2:3][CH2:4][CH2:5][CH2:6][CH2:7]1.[Cl:23][C:24]([O:25][CH2:26][CH:27]([CH3:28])[CH3:29])=[O:30].[OH2:44].[c:31]1([S:37][CH2:38][CH2:39][NH2:40])[cH:32][cH:33][cH:34][cH:35][cH:36]1>>[C:8]([CH3:9])([CH3:10])([CH3:11])[O:12][C:13](=[O:14])[NH:15][CH:16]([CH:17]([CH3:18])[CH3:19])[C:20](=[O:22])[NH:40][CH2:39][CH2:38][S:37][c:31]1[cH:32][cH:33][cH:34][cH:35][cH:36]1

Participants

7

Reactant 6

HCID 962WaterHCID 6344DichloromethaneHCID 12291N-MethylpiperidineHCID 37013Phenyl-2-aminoethyl sulfideHCID 62365Isobutyl chloroformateHCID 270655Boc-DL-valine

Product 1

HCID 178449815HCID 178449815, compound

Sources & evidence

ORD record
ord-438914f0edcc4e508cbfe7e16b7acd0b
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (10/10)

Reaction notes

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